About: Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations?

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About: Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? Goto Sponge NotDistinct Permalink

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rdf:type	Item
description	artículu científicu (ast) wetenschappelijk artikel (nl) наукова стаття, опублікована в грудні 2002 (uk) im Dezember 2002 veröffentlichter wissenschaftlicher Artikel (de) article scientifique publié en décembre 2002 (fr)
publication date	wds:Q61857970-131E6855-5F0B-413A-800D-BDD242E58402
publication date	2002-12-15 00:00:00Z (xsd:dateTime)
language of work or name	wds:Q61857970-6E2E2A9C-EA0F-4F3D-9774-D705462AEDE8
language of work or name	English
cites work	wds:Q61857970-08B7E20B-24DA-46A7-89F3-C70346E26E66 wds:Q61857970-2A1452E4-2536-4CAE-B4DF-989DB6293054 wds:Q61857970-3685A9C3-25DD-4DD9-9C81-97ADFF2BA402 wds:Q61857970-469A0225-1010-44A2-B9EE-85DCBD715AED wds:Q61857970-6AAAC117-5C90-4E38-A2F1-3222CD083CF6 wds:Q61857970-74530A3C-9E62-4443-B1C8-73966BEA269D wds:Q61857970-79BD6313-86BC-4EA4-8825-F618EFA4756C wds:Q61857970-8B1FB38E-D9BB-4D3D-9EE2-6FD8D9520762 wds:Q61857970-9806B03C-C143-455A-809C-91BA477C0571 wds:Q61857970-A08E3878-350C-44E3-BB49-0D1CC8244FCA wds:Q61857970-C358567B-D389-468D-9CE5-B56EF7A489A4 wds:Q61857970-CE60057F-4563-4F24-9040-1721339F0341 wds:Q61857970-FCF74426-EE80-4996-8382-7967621E1423
cites work	Density-functional thermochemistry. III. The role of exact exchange Conservation of orbital symmetry Quadratic configuration interaction. A general technique for determining electron correlation energies A Correlation of Reaction Rates Absolute hardness: companion parameter to absolute electronegativity Note on an Approximation Treatment for Many-Electron Systems Use of ab Initio Quantum Molecular Similarities as an Interpretative Tool for the Study of Chemical Reactions Absolute electronegativity and absolute hardness of Lewis acids and bases On the Validity of the Maximum Hardness and Minimum Polarizability Principles for Nontotally Symmetric Vibrations Woodward−Hoffmann Rule in the Light of the Principles of Maximum Hardness and Minimum Polarizability: DFT and Ab Initio SCF Studies Partial Charges on Atoms in Organic Compounds Correlation between Energy, Polarizability, and Hardness Profiles in the Isomerization Reaction of HNO and ClNO Density-Functional Approach to Hardness Evaluation and Its Use in the Study of the Maximum Hardness Principle
author name string	wds:Q61857970-5696C2CF-6F95-422E-B01F-670975A0E360
author name string	Miquel Torrent-Sucarrat
rdfs:label	Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? (en) Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? (nl)
skos:prefLabel	Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? (en) Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? (nl)
name	Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? (en) Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? (nl)
author	wds:Q61857970-116268CE-B09B-4169-B736-90855D999C32 wds:Q61857970-3B2B7852-6D23-4816-9713-0EB74229A0BE wds:Q61857970-CDC702A5-5F2F-461F-A605-3D6CBD89ED41
author	Miquel Duran Portas Josep M. Luis Miquel Solà i Puig
title	wds:Q61857970-93B158B6-8F27-43E4-8DB6-D002DB0FDFC9
title	Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? (en)
page(s)	wds:Q61857970-C0A4A523-9429-4020-81D0-A0A863475069
page(s)	10561-10570
instance of	wds:Q61857970-97593FD1-8626-48D6-A2E3-C5217E7DBE88
instance of	scholarly article
published in	wds:Q61857970-C3ED85D3-50CC-4535-A120-4E9445E22976
published in	Journal of Chemical Physics
issue	wds:Q61857970-1F8ACC32-6445-447E-AE93-2A63FB1A0330
volume	wds:Q61857970-C78A47A6-0AED-4601-A6C0-B0D91991BBDF
issue	23
volume	117
DOI	wds:Q61857970-4DCB4C36-CE02-4255-8D24-44F1D3FD78FA
DOI	http://dx.doi.org/10.1063/1.1517990
DOI	10.1063/1.1517990
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q61857970
is cites work of	Chapter 3 The breakdown of the maximum hardness and minimum polarizability principles for nontotally symmetric vibrations Imaginary Vibrational Modes in Polycyclic Aromatic Hydrocarbons: A Challenging Test for the Hardness Profiles
is cites work of	wds:Q62514065-7B4EE383-3991-4859-95C5-92719D89768F wds:Q63982339-BC718057-3E42-4617-9C9B-88A440BA67EF

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